Compile Data Set for Download or QSAR

Found 107 hits with Last Name = 'christian' and Initial = 'f'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
cAMP-specific 3',5'-cyclic phosphodiesterase 4A (Homo sapiens (Human))	BDBM50393511 (CHEMBL2158056) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1nc(-c2cccc(c2)-[#7+](-[#8-])=O)c2ncccc2c1=O Show InChI InChI=1S/C18H16N4O3/c1-12(2)8-10-21-18(23)15-7-4-9-19-17(15)16(20-21)13-5-3-6-14(11-13)22(24)25/h3-9,11H,10H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
University of Glasgow Curated by ChEMBL					Assay Description Inhibition of full-length PDE4A4 using cAMP as substrate by two-step radiochemical assay				J Med Chem 54: 3331-47 (2011) Article DOI: 10.1021/jm200070e BindingDB Entry DOI: 10.7270/Q2CF9R75
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A (Homo sapiens (Human))	BDBM50393510 (CHEMBL1232082) Show SMILES [O-][N+](=O)c1cccc(c1)-n1c2ncccc2c(=O)n(Cc2ccncc2)c1=O Show InChI InChI=1S/C19H13N5O4/c25-18-16-5-2-8-21-17(16)23(14-3-1-4-15(11-14)24(27)28)19(26)22(18)12-13-6-9-20-10-7-13/h1-11H,12H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
University of Glasgow Curated by ChEMBL					Assay Description Inhibition of full-length PDE4A4 using cAMP as substrate by two-step radiochemical assay				J Med Chem 54: 3331-47 (2011) Article DOI: 10.1021/jm200070e BindingDB Entry DOI: 10.7270/Q2CF9R75
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A (Homo sapiens (Human))	BDBM50085135 (4-(8-(3-nitrophenyl)-1,7-naphthyridin-6-yl)benzoic...) Show SMILES OC(=O)c1ccc(cc1)-c1cc2cccnc2c(n1)-c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C21H13N3O4/c25-21(26)14-8-6-13(7-9-14)18-12-16-4-2-10-22-19(16)20(23-18)15-3-1-5-17(11-15)24(27)28/h1-12H,(H,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
University of Glasgow Curated by ChEMBL					Assay Description Inhibition of full-length PDE4A4 using cAMP as substrate by two-step radiochemical assay				J Med Chem 54: 3331-47 (2011) Article DOI: 10.1021/jm200070e BindingDB Entry DOI: 10.7270/Q2CF9R75
					More data for this Ligand-Target Pair				3D Structure (crystal)
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515168 (CHEMBL4469291) Show SMILES Oc1cc(F)cc(F)c1S(=O)(=O)N1CCC2(CCC2)C1 Show InChI InChI=1S/C13H15F2NO3S/c14-9-6-10(15)12(11(17)7-9)20(18,19)16-5-4-13(8-16)2-1-3-13/h6-7,17H,1-5,8H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515126 (CHEMBL4451547) Show SMILES Oc1cc(F)ccc1S(=O)(=O)N1CCC2(CCC2)C1 Show InChI InChI=1S/C13H16FNO3S/c14-10-2-3-12(11(16)8-10)19(17,18)15-7-6-13(9-15)4-1-5-13/h2-3,8,16H,1,4-7,9H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515137 (CHEMBL4476837) Show SMILES Oc1cc(F)cc(F)c1C(=O)N1CCC2(CCC2)C1 Show InChI InChI=1S/C14H15F2NO2/c15-9-6-10(16)12(11(18)7-9)13(19)17-5-4-14(8-17)2-1-3-14/h6-7,18H,1-5,8H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	57	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515142 (CHEMBL4460134) Show SMILES Oc1cc(Cl)cc(Cl)c1S(=O)(=O)N1CCC2(CCC2)C1 Show InChI InChI=1S/C13H15Cl2NO3S/c14-9-6-10(15)12(11(17)7-9)20(18,19)16-5-4-13(8-16)2-1-3-13/h6-7,17H,1-5,8H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	83	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515156 (CHEMBL4542798) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCc2ccccc12 Show InChI InChI=1S/C15H11Cl2NO2/c16-10-7-11(17)14(13(19)8-10)15(20)18-6-5-9-3-1-2-4-12(9)18/h1-4,7-8,19H,5-6H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515170 (CHEMBL4483803) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCc2ccccc2C1 Show InChI InChI=1S/C16H13Cl2NO2/c17-12-7-13(18)15(14(20)8-12)16(21)19-6-5-10-3-1-2-4-11(10)9-19/h1-4,7-8,20H,5-6,9H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515183 (CHEMBL4566276) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C18H17Cl2NO2/c19-14-10-15(20)17(16(22)11-14)18(23)21-8-6-13(7-9-21)12-4-2-1-3-5-12/h1-5,10-11,13,22H,6-9H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	240	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515153 (CHEMBL4444034) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC(C1)Nc1ccccc1 Show InChI InChI=1S/C17H16Cl2N2O2/c18-11-8-14(19)16(15(22)9-11)17(23)21-7-6-13(10-21)20-12-4-2-1-3-5-12/h1-5,8-9,13,20,22H,6-7,10H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A (Homo sapiens (Human))	BDBM50108504 (4-(8-(benzo[c][1,2,5]oxadiazol-5-yl)-1,7-naphthyri...) Show SMILES OC(=O)c1ccc(cc1)-c1cc2cccnc2c(n1)-c1ccc2nonc2c1 Show InChI InChI=1S/C21H12N4O3/c26-21(27)13-5-3-12(4-6-13)17-10-14-2-1-9-22-19(14)20(23-17)15-7-8-16-18(11-15)25-28-24-16/h1-11H,(H,26,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	290	n/a	n/a	n/a	n/a	n/a	n/a
University of Glasgow Curated by ChEMBL					Assay Description Inhibition of full-length PDE4A4 using cAMP as substrate by two-step radiochemical assay				J Med Chem 54: 3331-47 (2011) Article DOI: 10.1021/jm200070e BindingDB Entry DOI: 10.7270/Q2CF9R75
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515125 (CHEMBL4562659) Show SMILES Oc1cccc(F)c1C(=O)N1CCC2(CCC2)C1 Show InChI InChI=1S/C14H16FNO2/c15-10-3-1-4-11(17)12(10)13(18)16-8-7-14(9-16)5-2-6-14/h1,3-4,17H,2,5-9H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	290	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515161 (CHEMBL4467218) Show SMILES Oc1cc(Cl)cnc1C(=O)N1CCC2(CCC2)C1 Show InChI InChI=1S/C13H15ClN2O2/c14-9-6-10(17)11(15-7-9)12(18)16-5-4-13(8-16)2-1-3-13/h6-7,17H,1-5,8H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515154 (CHEMBL4448675) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC(C1)Oc1cccnc1 Show InChI InChI=1S/C16H14Cl2N2O3/c17-10-6-13(18)15(14(21)7-10)16(22)20-5-3-12(9-20)23-11-2-1-4-19-8-11/h1-2,4,6-8,12,21H,3,5,9H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515123 (CHEMBL4448911) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC(Cc2ccccc2)CC1 Show InChI InChI=1S/C19H19Cl2NO2/c20-15-11-16(21)18(17(23)12-15)19(24)22-8-6-14(7-9-22)10-13-4-2-1-3-5-13/h1-5,11-12,14,23H,6-10H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM187258 (US9169234, 23) Show SMILES COCC(=O)NCCc1c(C)[nH]c2ccc(O)cc12 Show InChI InChI=1S/C14H18N2O3/c1-9-11(5-6-15-14(18)8-19-2)12-7-10(17)3-4-13(12)16-9/h3-4,7,16-17H,5-6,8H2,1-2H3,(H,15,18)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair				3D Structure (crystal)
cAMP-specific 3',5'-cyclic phosphodiesterase 4A (Homo sapiens (Human))	BDBM50393509 (PYRIDOPYRIDAZINONE) Show SMILES [O-][N+](=O)c1cccc(c1)-c1nn(Cc2ccncc2)c(=O)c2cccnc12 Show InChI InChI=1S/C19H13N5O3/c25-19-16-5-2-8-21-18(16)17(14-3-1-4-15(11-14)24(26)27)22-23(19)12-13-6-9-20-10-7-13/h1-11H,12H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	340	n/a	n/a	n/a	n/a	n/a	n/a
University of Glasgow Curated by ChEMBL					Assay Description Inhibition of full-length PDE4A4 using cAMP as substrate by two-step radiochemical assay				J Med Chem 54: 3331-47 (2011) Article DOI: 10.1021/jm200070e BindingDB Entry DOI: 10.7270/Q2CF9R75
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A (Homo sapiens (Human))	BDBM50393512 (CHEMBL2158057) Show SMILES Clc1cccc(c1)-c1nn(CC2CC2)c(=O)c2cccnc12 Show InChI InChI=1S/C17H14ClN3O/c18-13-4-1-3-12(9-13)15-16-14(5-2-8-19-16)17(22)21(20-15)10-11-6-7-11/h1-5,8-9,11H,6-7,10H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	340	n/a	n/a	n/a	n/a	n/a	n/a
University of Glasgow Curated by ChEMBL					Assay Description Inhibition of full-length PDE4A4 using cAMP as substrate by two-step radiochemical assay				J Med Chem 54: 3331-47 (2011) Article DOI: 10.1021/jm200070e BindingDB Entry DOI: 10.7270/Q2CF9R75
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515176 (CHEMBL4567010) Show SMILES Oc1cc(F)cnc1C(=O)N1CCC2(CCC2)C1 Show InChI InChI=1S/C13H15FN2O2/c14-9-6-10(17)11(15-7-9)12(18)16-5-4-13(8-16)2-1-3-13/h6-7,17H,1-5,8H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515150 (CHEMBL4437646) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC(C1)c1cccnc1 Show InChI InChI=1S/C16H14Cl2N2O2/c17-12-6-13(18)15(14(21)7-12)16(22)20-5-3-11(9-20)10-2-1-4-19-8-10/h1-2,4,6-8,11,21H,3,5,9H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	370	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515182 (CHEMBL4456501) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC(CCc2ccccc2)C1 Show InChI InChI=1S/C19H19Cl2NO2/c20-15-10-16(21)18(17(23)11-15)19(24)22-9-8-14(12-22)7-6-13-4-2-1-3-5-13/h1-5,10-11,14,23H,6-9,12H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515178 (CHEMBL4449470) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCCC2(CCC2)C1 Show InChI InChI=1S/C15H17Cl2NO2/c16-10-7-11(17)13(12(19)8-10)14(20)18-6-2-5-15(9-18)3-1-4-15/h7-8,19H,1-6,9H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	460	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515169 (CHEMBL4521562) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC(C1)c1ccccc1 Show InChI InChI=1S/C17H15Cl2NO2/c18-13-8-14(19)16(15(21)9-13)17(22)20-7-6-12(10-20)11-4-2-1-3-5-11/h1-5,8-9,12,21H,6-7,10H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	520	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A (Homo sapiens (Human))	BDBM50042058 ((-)-rolipram | (4R)-4-[3-(cyclopentyloxy)-4-methox...) Show SMILES COc1ccc(cc1OC1CCCC1)[C@@H]1CNC(=O)C1 Show InChI InChI=1S/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)/t12-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
University of Glasgow Curated by ChEMBL					Assay Description Inhibition of full-length PDE4A4 using cAMP as substrate by two-step radiochemical assay				J Med Chem 54: 3331-47 (2011) Article DOI: 10.1021/jm200070e BindingDB Entry DOI: 10.7270/Q2CF9R75
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515122 (CHEMBL4586653) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC(Cc2ccncc2)C1 Show InChI InChI=1S/C17H16Cl2N2O2/c18-13-8-14(19)16(15(22)9-13)17(23)21-6-3-12(10-21)7-11-1-4-20-5-2-11/h1-2,4-5,8-9,12,22H,3,6-7,10H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515159 (CHEMBL4442449) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC2(CCC2)C1 Show InChI InChI=1S/C14H15Cl2NO2/c15-9-6-10(16)12(11(18)7-9)13(19)17-5-4-14(8-17)2-1-3-14/h6-7,18H,1-5,8H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	580	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair				3D Structure (crystal)
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515181 (CHEMBL4566899) Show SMILES Cn1cc(cn1)C1CCN(C1)C(=O)c1c(O)cc(Cl)cc1Cl Show InChI InChI=1S/C15H15Cl2N3O2/c1-19-7-10(6-18-19)9-2-3-20(8-9)15(22)14-12(17)4-11(16)5-13(14)21/h4-7,9,21H,2-3,8H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515158 (CHEMBL4472433) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC(CC1)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C18H17Cl2NO4S/c19-12-10-15(20)17(16(22)11-12)18(23)21-8-6-14(7-9-21)26(24,25)13-4-2-1-3-5-13/h1-5,10-11,14,22H,6-9H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515171 (CHEMBL4453841) Show SMILES Oc1cccnc1C(=O)N1CCC2(CCC2)C1 Show InChI InChI=1S/C13H16N2O2/c16-10-3-1-7-14-11(10)12(17)15-8-6-13(9-15)4-2-5-13/h1,3,7,16H,2,4-6,8-9H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	610	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515165 (CHEMBL4585262) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC(Cc2cccnc2)C1 Show InChI InChI=1S/C17H16Cl2N2O2/c18-13-7-14(19)16(15(22)8-13)17(23)21-5-3-12(10-21)6-11-2-1-4-20-9-11/h1-2,4,7-9,12,22H,3,5-6,10H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	610	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515151 (CHEMBL4464504) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC(C1)c1ccncc1 Show InChI InChI=1S/C16H14Cl2N2O2/c17-12-7-13(18)15(14(21)8-12)16(22)20-6-3-11(9-20)10-1-4-19-5-2-10/h1-2,4-5,7-8,11,21H,3,6,9H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	620	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515128 (CHEMBL4519901) Show SMILES Oc1cc(F)cc(Cl)c1C(=O)N1CCC2(CCC2)C1 Show InChI InChI=1S/C14H15ClFNO2/c15-10-6-9(16)7-11(18)12(10)13(19)17-5-4-14(8-17)2-1-3-14/h6-7,18H,1-5,8H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	670	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515157 (CHEMBL4460459) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCCc2ccccc12 Show InChI InChI=1S/C16H13Cl2NO2/c17-11-8-12(18)15(14(20)9-11)16(21)19-7-3-5-10-4-1-2-6-13(10)19/h1-2,4,6,8-9,20H,3,5,7H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	680	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A (Homo sapiens (Human))	BDBM50393518 (CHEMBL2158064) Show SMILES COc1ccc(cc1OC1CCCC1)[C@H]1CN(Cc2ccccc2)C(=O)C1 |r| Show InChI InChI=1S/C23H27NO3/c1-26-21-12-11-18(13-22(21)27-20-9-5-6-10-20)19-14-23(25)24(16-19)15-17-7-3-2-4-8-17/h2-4,7-8,11-13,19-20H,5-6,9-10,14-16H2,1H3/t19-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	730	n/a	n/a	n/a	n/a	n/a	n/a
University of Glasgow Curated by ChEMBL					Assay Description Inhibition of full-length PDE4A4 using cAMP as substrate by two-step radiochemical assay				J Med Chem 54: 3331-47 (2011) Article DOI: 10.1021/jm200070e BindingDB Entry DOI: 10.7270/Q2CF9R75
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515152 (CHEMBL4513537) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC(Cc2ccccc2)C1 Show InChI InChI=1S/C18H17Cl2NO2/c19-14-9-15(20)17(16(22)10-14)18(23)21-7-6-13(11-21)8-12-4-2-1-3-5-12/h1-5,9-10,13,22H,6-8,11H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	740	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515180 (CHEMBL4470398) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC(C1)c1ccccn1 Show InChI InChI=1S/C16H14Cl2N2O2/c17-11-7-12(18)15(14(21)8-11)16(22)20-6-4-10(9-20)13-3-1-2-5-19-13/h1-3,5,7-8,10,21H,4,6,9H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	790	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A (Homo sapiens (Human))	BDBM14361 ((R,S)-Rolipram | 4-(3-cyclopentyloxy-4-methoxy-phe...) Show SMILES COc1ccc(cc1OC1CCCC1)C1CNC(=O)C1 Show InChI InChI=1S/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	830	n/a	n/a	n/a	n/a	n/a	n/a
University of Glasgow Curated by ChEMBL					Assay Description Inhibition of full-length PDE4A4 using cAMP as substrate by two-step radiochemical assay				J Med Chem 54: 3331-47 (2011) Article DOI: 10.1021/jm200070e BindingDB Entry DOI: 10.7270/Q2CF9R75
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515145 (CHEMBL4556522) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC2(CC2)C1 Show InChI InChI=1S/C13H13Cl2NO2/c14-8-5-9(15)11(10(17)6-8)12(18)16-4-3-13(7-16)1-2-13/h5-6,17H,1-4,7H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	980	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A (Homo sapiens (Human))	BDBM50393515 (CHEMBL2158061) Show SMILES COc1ccc(cc1OC1CCCC1)[C@@H]1CN(C)C(=O)C1 |r| Show InChI InChI=1S/C17H23NO3/c1-18-11-13(10-17(18)19)12-7-8-15(20-2)16(9-12)21-14-5-3-4-6-14/h7-9,13-14H,3-6,10-11H2,1-2H3/t13-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Glasgow Curated by ChEMBL					Assay Description Inhibition of full-length PDE4A4 using cAMP as substrate by two-step radiochemical assay				J Med Chem 54: 3331-47 (2011) Article DOI: 10.1021/jm200070e BindingDB Entry DOI: 10.7270/Q2CF9R75
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A (Homo sapiens (Human))	BDBM50240404 ((Ibudilast)1-(2-Isopropyl-pyrazolo[1,5-a]pyridin-3...) Show SMILES CC(C)C(=O)c1c(nn2ccccc12)C(C)C Show InChI InChI=1S/C14H18N2O/c1-9(2)13-12(14(17)10(3)4)11-7-5-6-8-16(11)15-13/h5-10H,1-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents	DrugBank Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Glasgow Curated by ChEMBL					Assay Description Inhibition of full-length PDE4A4 using cAMP as substrate by two-step radiochemical assay				J Med Chem 54: 3331-47 (2011) Article DOI: 10.1021/jm200070e BindingDB Entry DOI: 10.7270/Q2CF9R75
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515164 (CHEMBL4579131) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC(C1)C(F)(F)F Show InChI InChI=1S/C12H10Cl2F3NO2/c13-7-3-8(14)10(9(19)4-7)11(20)18-2-1-6(5-18)12(15,16)17/h3-4,6,19H,1-2,5H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.31E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515172 (CHEMBL4546968) Show SMILES Oc1cccc(Cl)c1C(=O)N1CCC2(CCC2)C1 Show InChI InChI=1S/C14H16ClNO2/c15-10-3-1-4-11(17)12(10)13(18)16-8-7-14(9-16)5-2-6-14/h1,3-4,17H,2,5-9H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.45E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515141 (CHEMBL4518154) Show SMILES Oc1cncnc1C(=O)N1CCC2(CCC2)C1 Show InChI InChI=1S/C12H15N3O2/c16-9-6-13-8-14-10(9)11(17)15-5-4-12(7-15)2-1-3-12/h6,8,16H,1-5,7H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.55E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515175 (CHEMBL4464213) Show SMILES Oc1cc(Cl)c(F)c(Cl)c1C(=O)N1CCC2(CCC2)C1 Show InChI InChI=1S/C14H14Cl2FNO2/c15-8-6-9(19)10(11(16)12(8)17)13(20)18-5-4-14(7-18)2-1-3-14/h6,19H,1-5,7H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.57E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A (Homo sapiens (Human))	BDBM50040348 (8-Amino-1,3-bis-cyclopropylmethyl-3,7-dihydro-puri...) Show SMILES Nc1nc2n(CC3CC3)c(=O)n(CC3CC3)c(=O)c2[nH]1 Show InChI InChI=1S/C13H17N5O2/c14-12-15-9-10(16-12)17(5-7-1-2-7)13(20)18(11(9)19)6-8-3-4-8/h7-8H,1-6H2,(H3,14,15,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Glasgow Curated by ChEMBL					Assay Description Inhibition of full-length PDE4A4 using cAMP as substrate by two-step radiochemical assay				J Med Chem 54: 3331-47 (2011) Article DOI: 10.1021/jm200070e BindingDB Entry DOI: 10.7270/Q2CF9R75
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515179 (CHEMBL4564252) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC2(COC2)C1 Show InChI InChI=1S/C13H13Cl2NO3/c14-8-3-9(15)11(10(17)4-8)12(18)16-2-1-13(5-16)6-19-7-13/h3-4,17H,1-2,5-7H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.68E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515149 (CHEMBL4590824) Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCCC1 Show InChI InChI=1S/C11H11Cl2NO2/c12-7-5-8(13)10(9(15)6-7)11(16)14-3-1-2-4-14/h5-6,15H,1-4H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.99E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
Sepiapterin reductase (Homo sapiens (Human))	BDBM50515166 (CHEMBL4557426) Show SMILES CN(C)c1cc(O)c(C(=O)N2CCC3(CCC3)C2)c(Cl)c1 Show InChI InChI=1S/C16H21ClN2O2/c1-18(2)11-8-12(17)14(13(20)9-11)15(21)19-7-6-16(10-19)4-3-5-16/h8-9,20H,3-7,10H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.32E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gr�nenthal GmbH Curated by ChEMBL					Assay Description Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis				J Med Chem 62: 6391-6397 (2019) Article DOI: 10.1021/acs.jmedchem.9b00218 BindingDB Entry DOI: 10.7270/Q2JW8J6W
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A (Homo sapiens (Human))	BDBM50393516 (CHEMBL2158062) Show SMILES COc1ccc(cc1OC1CCCC1)[C@H]1CN(C)C(=O)C1 |r| Show InChI InChI=1S/C17H23NO3/c1-18-11-13(10-17(18)19)12-7-8-15(20-2)16(9-12)21-14-5-3-4-6-14/h7-9,13-14H,3-6,10-11H2,1-2H3/t13-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Glasgow Curated by ChEMBL					Assay Description Inhibition of full-length PDE4A4 using cAMP as substrate by two-step radiochemical assay				J Med Chem 54: 3331-47 (2011) Article DOI: 10.1021/jm200070e BindingDB Entry DOI: 10.7270/Q2CF9R75
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 107 total )  |  Next  |  Last  >>

Jump to: